#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xf7 s PRO 2 N 0.00 3.37 0.20 -1.58 0.04 -1.26 -4.63 135.00 131.14 1xf7 s PRO 2 Ca 0.00 2.24 0.11 0.00 0.04 0.00 0.00 61.00 63.39 1xf7 s PRO 2 Cb 0.00 -2.40 -0.04 0.00 0.04 0.00 0.00 34.50 32.10 1xf7 s PRO 2 CO 0.00 -1.01 -0.23 -0.06 0.04 0.00 0.00 177.00 175.75 1xf7 s PHE 3 N -1.29 2.25 0.04 0.56 0.08 -0.80 -4.96 117.98 113.85 1xf7 s PHE 3 Ca 0.67 -0.37 -0.02 0.00 0.12 0.00 0.00 56.93 57.34 1xf7 s PHE 3 Cb -0.40 -1.09 -0.02 0.00 -0.57 0.00 0.00 43.02 40.93 1xf7 s PHE 3 CO 0.49 0.51 0.00 -1.14 -0.10 0.00 0.00 175.22 174.99 1xf7 s GLN 4 N -2.81 0.49 0.03 0.44 0.74 -1.26 -0.48 119.66 116.81 1xf7 s GLN 4 Ca 0.22 -0.87 -0.15 0.00 0.05 0.00 0.00 55.36 54.60 1xf7 s GLN 4 Cb -0.07 0.18 -0.06 0.00 1.10 0.00 0.00 33.01 34.16 1xf7 s GLN 4 CO 0.10 -0.10 0.44 0.00 -0.55 0.00 0.00 175.29 175.19 1xf7 n LYS 6 N 1.65 2.48 0.00 0.00 0.00 -1.26 -2.55 118.16 118.47 1xf7 n LYS 6 Ca -0.12 -3.03 0.00 0.00 -0.00 0.00 0.00 58.31 55.16 1xf7 n LYS 6 Cb 0.52 -2.18 0.00 0.00 -0.00 0.00 0.00 35.03 33.37 1xf7 n LYS 6 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.40 179.81 1xf7 n THR 7 N -0.99 0.00 -0.24 0.58 -1.04 -1.26 -4.87 114.28 106.45 1xf7 n THR 7 Ca 0.56 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.57 1xf7 n THR 7 Cb 1.62 -0.49 0.00 0.00 -1.82 0.00 0.00 70.33 69.64 1xf7 n THR 7 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1xf7 n GLN 9 N -0.06 -1.66 -4.21 0.00 3.00 -1.06 -5.01 117.38 108.38 1xf7 n GLN 9 Ca 0.00 0.66 -0.30 0.00 -0.01 0.00 0.00 57.00 57.35 1xf7 n GLN 9 Cb 0.06 -4.87 -0.10 0.00 0.00 0.00 0.00 30.24 25.33 1xf7 n GLN 9 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.06 177.56 1xf7 s ARG 10 N -5.21 2.17 0.27 -1.09 3.52 -1.26 -4.88 118.95 112.47 1xf7 s ARG 10 Ca 0.45 -1.00 0.09 0.00 -0.13 0.00 0.00 55.73 55.14 1xf7 s ARG 10 Cb -0.12 -2.33 -0.04 0.00 -1.56 0.00 0.00 34.95 30.90 1xf7 s ARG 10 CO 0.81 0.51 0.06 -1.59 -0.81 0.00 0.00 175.30 174.28 1xf7 s LYS 11 N -2.23 2.47 0.30 5.12 -2.85 -1.26 -0.59 119.74 120.70 1xf7 s LYS 11 Ca 0.22 -1.32 0.04 0.00 -1.00 0.00 0.00 55.97 53.90 1xf7 s LYS 11 Cb -0.11 -2.27 -0.03 0.00 -2.06 0.00 0.00 37.83 33.35 1xf7 s LYS 11 CO 0.14 0.36 0.19 -0.06 0.10 0.00 0.00 175.35 176.09 1xf7 s PHE 12 N -2.28 1.58 -0.24 1.78 0.08 0.37 -4.96 117.98 114.31 1xf7 s PHE 12 Ca 0.32 -1.46 -0.01 0.00 0.12 0.00 0.00 56.93 55.90 1xf7 s PHE 12 Cb -0.07 -0.78 -0.18 0.00 -0.57 0.00 0.00 43.02 41.43 1xf7 s PHE 12 CO 0.21 -0.64 -0.15 -1.13 -0.10 0.00 0.00 175.22 173.41 1xf7 n SER 13 N -1.03 2.00 -4.71 1.36 3.41 -1.26 -1.90 113.62 111.48 1xf7 n SER 13 Ca 0.03 -0.05 -0.24 0.00 -0.26 0.00 0.00 58.87 58.34 1xf7 n SER 13 Cb 0.64 -0.51 -0.07 0.00 -0.26 0.00 0.00 64.21 64.01 1xf7 n SER 13 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1xf7 s ARG 14 N -2.52 2.23 0.04 4.33 0.52 -1.26 -4.58 118.95 117.71 1xf7 s ARG 14 Ca -0.34 -1.73 -0.06 0.00 -0.52 0.00 0.00 55.73 53.08 1xf7 s ARG 14 Cb 0.09 -2.02 -0.29 0.00 0.52 0.00 0.00 34.95 33.24 1xf7 s ARG 14 CO 0.62 0.01 1.01 0.66 0.02 0.00 0.00 175.30 177.62 1xf7 h SER 15 N 1.56 0.49 0.18 0.23 4.64 -1.95 -2.71 113.55 115.99 1xf7 h SER 15 Ca -0.43 -0.57 -0.05 0.00 -0.47 0.00 0.00 61.79 60.27 1xf7 h SER 15 Cb 1.25 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 63.18 1xf7 h SER 15 CO 0.67 1.46 -0.22 -2.24 -0.87 0.00 0.00 176.83 175.63 1xf7 h ASP 16 N 0.08 0.08 0.64 4.97 3.04 -1.99 -1.01 116.42 122.23 1xf7 h ASP 16 Ca -0.20 -0.02 -0.03 0.00 -3.24 0.00 0.00 57.03 53.54 1xf7 h ASP 16 Cb 2.02 -0.02 0.01 0.00 -1.04 0.00 0.00 39.33 40.30 1xf7 h ASP 16 CO 0.20 0.30 -0.31 0.45 -2.04 0.00 0.00 179.24 177.85 1xf7 h HIS 17 N 0.08 -0.80 -0.79 4.15 3.86 -1.95 -2.42 115.15 117.27 1xf7 h HIS 17 Ca 0.01 -0.02 0.14 0.00 -1.16 0.00 0.00 60.37 59.35 1xf7 h HIS 17 Cb 0.43 0.26 -0.14 0.00 1.06 0.00 0.00 27.41 29.02 1xf7 h HIS 17 CO 0.00 -0.49 -0.30 1.25 0.86 0.00 0.00 177.93 179.25 1xf7 h LEU 18 N -1.19 -1.09 -0.02 2.43 5.85 -1.13 -1.59 115.31 118.57 1xf7 h LEU 18 Ca -0.09 0.26 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1xf7 h LEU 18 Cb 0.66 0.60 -0.03 0.00 0.37 0.00 0.00 40.66 42.26 1xf7 h LEU 18 CO 0.14 -0.29 -0.25 0.11 -0.34 0.00 0.00 178.44 177.82 1xf7 h LYS 19 N -0.06 -0.29 -0.91 1.25 1.79 -1.19 -1.74 116.57 115.43 1xf7 h LYS 19 Ca 0.33 0.02 0.26 0.00 -2.18 0.00 0.00 60.65 59.07 1xf7 h LYS 19 Cb 0.59 0.07 -0.15 0.00 -1.58 0.00 0.00 32.23 31.15 1xf7 h LYS 19 CO -0.83 -0.19 0.20 1.15 -1.08 0.00 0.00 179.45 178.70 1xf7 h THR 20 N -0.30 0.22 0.86 -0.16 2.02 -0.87 -2.20 112.91 112.48 1xf7 h THR 20 Ca 0.01 -0.05 -0.04 0.00 0.77 0.00 0.00 66.41 67.10 1xf7 h THR 20 Cb 0.33 0.07 0.00 0.00 -1.74 0.00 0.00 68.15 66.81 1xf7 h THR 20 CO -0.18 0.03 -0.48 -0.74 0.37 0.00 0.00 175.52 174.52 1xf7 h HIS 21 N 0.14 -1.27 -0.28 3.16 -0.00 -0.64 -3.04 115.15 113.22 1xf7 h HIS 21 Ca 0.58 -0.02 0.08 0.00 -0.00 0.00 0.00 60.37 61.01 1xf7 h HIS 21 Cb 1.22 0.44 -0.01 0.00 -0.00 0.00 0.00 27.41 29.06 1xf7 h HIS 21 CO -0.31 -0.74 0.79 1.15 -0.00 0.00 0.00 177.93 178.83 1xf7 h THR 22 N -1.24 0.05 -0.45 6.26 2.02 -0.68 -2.28 112.91 116.58 1xf7 h THR 22 Ca -0.12 0.00 0.13 0.00 0.77 0.00 0.00 66.41 67.19 1xf7 h THR 22 Cb 0.98 0.27 -0.02 0.00 -1.74 0.00 0.00 68.15 67.64 1xf7 h THR 22 CO 0.15 0.00 0.59 0.08 0.37 0.00 0.00 175.52 176.71 1xf7 h ARG 23 N 0.00 0.00 -0.06 6.66 0.11 -1.51 0.23 114.38 119.81 1xf7 h ARG 23 Ca 0.13 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.21 1xf7 h ARG 23 Cb 1.72 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.80 1xf7 h ARG 23 CO -0.00 0.00 0.00 -2.37 0.10 0.00 0.00 179.97 177.70 1xf7 n THR 24 N -3.46 0.08 0.01 0.08 5.66 -0.86 -0.51 114.28 115.28 1xf7 n THR 24 Ca 0.09 -0.10 0.00 0.00 -3.05 0.00 0.00 64.05 60.99 1xf7 n THR 24 Cb 0.77 -0.04 0.00 0.00 -1.55 0.00 0.00 70.33 69.51 1xf7 n THR 24 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 175.07 173.43 1xf7 n HIS 25 N -0.39 -0.05 -0.09 1.09 8.25 0.72 -4.82 115.22 119.93 1xf7 n HIS 25 Ca 0.08 0.01 -0.08 0.00 -0.26 0.00 0.00 57.72 57.47 1xf7 n HIS 25 Cb 0.10 0.11 -0.15 0.00 1.12 0.00 0.00 29.99 31.17 1xf7 n HIS 25 CO 0.00 0.00 0.00 2.41 0.64 0.00 0.00 176.34 179.39 1xf7 n THR 26 N -2.95 1.20 -1.26 1.59 -1.04 -0.73 -4.23 114.28 106.86 1xf7 n THR 26 Ca 0.00 -0.77 -0.29 0.00 -2.04 0.00 0.00 64.05 60.96 1xf7 n THR 26 Cb 0.36 -0.48 0.13 0.00 -1.82 0.00 0.00 70.33 68.52 1xf7 n THR 26 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1xf7 n GLY 27 N 1.84 5.13 1.65 3.41 0.00 0.33 -4.27 105.19 113.28 1xf7 n GLY 27 Ca -0.29 -1.65 0.00 0.00 0.00 0.00 0.00 46.02 44.08 1xf7 n GLY 27 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1xf7 n GLU 28 N -1.03 0.00 0.00 1.61 0.00 -0.96 -4.73 120.64 115.53 1xf7 n GLU 28 Ca 0.61 0.00 0.03 0.00 0.00 0.00 0.00 57.16 57.80 1xf7 n GLU 28 Cb 1.19 -0.18 0.02 0.00 0.00 0.00 0.00 31.44 32.47 1xf7 n GLU 28 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.13 177.49